[2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol

C14H24N4O2 — CID 106367984

IUPAC[2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol
SMILESCCNc1cc(NC2CCCC2CO)nc(COC)n1
InChIInChI=1S/C14H24N4O2/c1-3-15-12-7-13(18-14(17-12)9-20-2)16-11-6-4-5-10(11)8-19/h7,10-11,19H,3-6,8-9H2,1-2H3,(H2,15,16,17,18)
InChIKeyYSYFVZOMJYXPGT-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.63
Rot. Bonds7

About [2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol

[2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol (PubChem CID 106367984) has the molecular formula C14H24N4O2 and a molecular weight of 280.37 g/mol. Its IUPAC name is [2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol
PubChem CID106367984
Molecular FormulaC14H24N4O2
Molecular Weight280.37 g/mol
Exact Mass280.19
IUPAC Name[2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol
SMILESCCNc1cc(NC2CCCC2CO)nc(COC)n1
InChIInChI=1S/C14H24N4O2/c1-3-15-12-7-13(18-14(17-12)9-20-2)16-11-6-4-5-10(11)8-19/h7,10-11,19H,3-6,8-9H2,1-2H3,(H2,15,16,17,18)
InChIKeyYSYFVZOMJYXPGT-UHFFFAOYSA-N
XLogP1.63
TPSA79.30 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol?
The IUPAC name of [2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol (CID 106367984) is [2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol.
What is the SMILES notation for [2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol?
The canonical SMILES for [2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol is CCNc1cc(NC2CCCC2CO)nc(COC)n1.
What is the InChIKey of [2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol?
The InChIKey is YSYFVZOMJYXPGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O2/c1-3-15-12-7-13(18-14(17-12)9-20-2)16-11-6-4-5-10(11)8-19/h7,10-11,19H,3-6,8-9H2,1-2H3,(H2,15,16,17,18).
What are the key properties of [2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol?
[2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol has a molecular weight of 280.37 g/mol, XLogP of 1.63, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol is sourced from PubChem (CID 106367984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).